A1JCS
Summary
| Name: | 2-azanyl-6-cyclopentyl-7~{H}-pyrrolo[3,4-d]pyrimidin-5-one |
| Formula: | C11 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 218.255 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-azanyl-6-cyclopentyl-7~{H}-pyrrolo[3,4-d]pyrimidin-5-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H14N4O/c12-11-13-5-8-9(14-11)6-15(10(8)16)7-3-1-2-4-7/h5,7H,1-4,6H2,(H2,12,13,14) |
| InChIKey | InChI | 1.06 | RUUUZPDEYNEEEZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ncc2C(=O)N(Cc2n1)C3CCCC3 |
| SMILES | CACTVS | 3.385 | Nc1ncc2C(=O)N(Cc2n1)C3CCCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c2c(nc(n1)N)CN(C2=O)C3CCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c2c(nc(n1)N)CN(C2=O)C3CCCC3 |
